| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 15 | Yes |
Popular Name: (2S)-N2-methyl-N2-[(1S)-1-methylpropyl]octane-1,2-diamine (2S)-N2-methyl-N2-[(1S)-1-methyl…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.30 | 4.92 | -38.97 | 3 | 2 | 1 | 31 | 215.405 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 6.51 | -26.72 | 3 | 2 | 1 | 30 | 215.405 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 6.92 | -115.14 | 4 | 2 | 2 | 32 | 216.413 | 9 | ↓ |
